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87696-44-4 | Oxazole, 2-(5-hexenyl)-4,5-diphenyl-
CAS No: 87696-44-4 Catalog No: AG004NRW MDL No:
Product Description
Catalog Number:
AG004NRW
Chemical Name:
Oxazole, 2-(5-hexenyl)-4,5-diphenyl-
CAS Number:
87696-44-4
Molecular Formula:
C21H21NO
Molecular Weight:
303.3975
IUPAC Name:
2-hex-5-enyl-4,5-diphenyl-1,3-oxazole
InChI:
InChI=1S/C21H21NO/c1-2-3-4-11-16-19-22-20(17-12-7-5-8-13-17)21(23-19)18-14-9-6-10-15-18/h2,5-10,12-15H,1,3-4,11,16H2
InChI Key:
WRFXDBFLZWQMBS-UHFFFAOYSA-N
SMILES:
C=CCCCCc1nc(c(o1)c1ccccc1)c1ccccc1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.162g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.405g/mol
Monoisotopic Mass:
303.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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